input word = C00035709

Metabolite InformationStructural formula
Name Oreskaurin A
(-)-Oreskaurin A
Formula C22H28O8
Mw 420.17841787
CAS RN 720666-97-7
C_ID C00035709 ,
InChIKey XESCNAZYJNKEGK-XVLSNYNVNA-N
InChICode InChI=1S/C22H28O8/c1-10-12-6-13(24)15-21(7-12,17(10)26)19(27)29-9-22(15)14(25)4-5-20(3)8-28-18(16(20)22)30-11(2)23/h12-16,18,24-25H,1,4-9H2,2-3H3/t12-,13-,14-,15+,16-,18-,20+,21+,22+/m1/s1
SMILES [C@H]1(C[C@H]2C(=C)C(=O)[C@@]3([C@H]1[C@@]1(COC3=O)[C@H]3[C@@](CC[C@H]1O)(CO[C@@H]3OC(=O)C)C)C2)O
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeLabiataeIsodon oresbia Ref.
PlantaeLabiataeIsodon oresbius Ref.
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